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Boc-Ile-OMe

CAS No.:
17901-01-8
Catalog Number:
AG0026P2
Molecular Formula:
C12H23NO4
Molecular Weight:
245.3153
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$69
- +
5g
97%
In Stock USA
United States
$169
- +
25g
97%
In Stock USA
United States
$607
- +
Product Description
Catalog Number:
AG0026P2
Chemical Name:
Boc-Ile-OMe
CAS Number:
17901-01-8
Molecular Formula:
C12H23NO4
Molecular Weight:
245.3153
MDL Number:
MFCD00038761
IUPAC Name:
methyl (2S,3S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate
InChI:
InChI=1S/C12H23NO4/c1-7-8(2)9(10(14)16-6)13-11(15)17-12(3,4)5/h8-9H,7H2,1-6H3,(H,13,15)/t8-,9-/m0/s1
InChI Key:
KLRYBAAAYDFIEQ-IUCAKERBSA-N
SMILES:
CC[C@@H]([C@@H](C(=O)OC)NC(=O)OC(C)(C)C)C
Properties
Complexity:
270  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
2  
Defined Bond Stereocenter Count:
0
Exact Mass:
245.163g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.319g/mol
Monoisotopic Mass:
245.163g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
64.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties